PF-1760

Details

Stereochemistry	ACHIRAL
Molecular Formula	C21H28N2O5S
Molecular Weight	420.522
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCCCNC1=CC(=CC(=C1OC2=CC=CC=C2)S(N)(=O)=O)C(=O)OCCCC

InChI

InChIKey=FUBXAOXPLXHBPG-UHFFFAOYSA-N

InChI=1S/C21H28N2O5S/c1-3-5-12-23-18-14-16(21(24)27-13-6-4-2)15-19(29(22,25)26)20(18)28-17-10-8-7-9-11-17/h7-11,14-15,23H,3-6,12-13H2,1-2H3,(H2,22,25,26)

HIDE SMILES / InChI

Molecular Formula	C21H28N2O5S
Molecular Weight	420.522
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Wed Apr 02 11:42:42 GMT 2025` Edited by `admin` on `Wed Apr 02 11:42:42 GMT 2025`
Record UNII	NBS61YGN42
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

PF-1760

Code

English

BUMETANIDE BUTYL ESTER

Preferred Name

English

BUTYL 3-(BUTYLAMINO)-4-PHENOXY-5-SULFAMOYLBENZOATE

Systematic Name

English

BENZOIC ACID, 3-(AMINOSULFONYL)-5-(BUTYLAMINO)-4-PHENOXY-, BUTYL ESTER

Systematic Name

English

BUTYL 3-(BUTYLAMINO)-4-PHENOXY-5-SULFAMOYLBENZOATE [USP-RS]

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID30186326